5-methyl-N-[2-(methylsulfanyl)phenyl]-4,5,6,7-tetrahydro-1,2-benzoxazole-3-carboxamide
Chemical Structure Depiction of
5-methyl-N-[2-(methylsulfanyl)phenyl]-4,5,6,7-tetrahydro-1,2-benzoxazole-3-carboxamide
5-methyl-N-[2-(methylsulfanyl)phenyl]-4,5,6,7-tetrahydro-1,2-benzoxazole-3-carboxamide
Compound characteristics
| Compound ID: | E920-0671 |
| Compound Name: | 5-methyl-N-[2-(methylsulfanyl)phenyl]-4,5,6,7-tetrahydro-1,2-benzoxazole-3-carboxamide |
| Molecular Weight: | 302.39 |
| Molecular Formula: | C16 H18 N2 O2 S |
| Smiles: | CC1CCc2c(C1)c(C(Nc1ccccc1SC)=O)no2 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.6306 |
| logD: | 3.6305 |
| logSw: | -3.9672 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 45.032 |
| InChI Key: | MZYZPQFCPDRRFP-SNVBAGLBSA-N |